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Home > Indoles and Oxindole > 603-76-9
603-76-9 | 1-Methyl-1H-indole
CAS No: 603-76-9 Catalog No: AG003EIP MDL No:MFCD00005800
Product Description
Catalog Number:
AG003EIP
Chemical Name:
1-Methyl-1H-indole
CAS Number:
603-76-9
Molecular Formula:
C9H9N
Molecular Weight:
131.1745
MDL Number:
MFCD00005800
IUPAC Name:
1-methylindole
InChI:
InChI=1S/C9H9N/c1-10-7-6-8-4-2-3-5-9(8)10/h2-7H,1H3
InChI Key:
BLRHMMGNCXNXJL-UHFFFAOYSA-N
SMILES:
Cn1ccc2c1cccc2
EC Number:
210-057-5
UNII:
8H698ROJ5F
NSC Number:
212534
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.073g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
131.178g/mol
Monoisotopic Mass:
131.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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